2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone

C128H137N25O9S3 — CID 158085088

About 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone

2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone (PubChem CID 158085088) has the molecular formula C128H137N25O9S3 and a molecular weight of 2265.87 g/mol. Its IUPAC name is 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone.

Molecular Properties

• Compound Name: 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone
• PubChem CID: 158085088
• Molecular Formula: C128H137N25O9S3
• Molecular Weight: 2265.87 g/mol
• Exact Mass: 2264.02
• IUPAC Name: 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone
• SMILES: CN1CCN(c2ccc(C(=O)Cc3cc(-c4ccco4)ccc3N)nc2)CC1.CN1CCN(c2ccc(C(=O)Cc3cc(-c4ccoc4)ccc3N)nc2)CC1.CN1CCN(c2ncc(C(=O)Cc3cc(-c4ccccc4)ccc3N)s2)CC1.Nc1ccc(-c2ccccc2)cc1CC(=O)c1cnc(N2CCNCC2)s1.Nc1ccc(-c2ccccn2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2ccoc2)cc1CC(=O)c1cnc(N2CCNCC2)s1
• InChI: InChI=1S/C22H23N5O.2C22H24N4O2.C22H24N4OS.C21H22N4OS.C19H20N4O2S/c23-19-6-4-16(20-3-1-2-8-25-20)13-17(19)14-22(28)21-7-5-18(15-26-21)27-11-9-24-10-12-27;1-25-7-9-26(10-8-25)19-3-5-21(24-14-19)22(27)13-18-12-16(2-4-20(18)23)17-6-11-28-15-17;1-25-8-10-26(11-9-25)18-5-7-20(24-15-18)21(27)14-17-13-16(4-6-19(17)23)22-3-2-12-28-22;1-25-9-11-26(12-10-25)22-24-15-21(28-22)20(27)14-18-13-17(7-8-19(18)23)16-5-3-2-4-6-16;22-18-7-6-16(15-4-2-1-3-5-15)12-17(18)13-19(26)20-14-24-21(27-20)25-10-8-23-9-11-25;20-16-2-1-13(14-3-8-25-12-14)9-15(16)10-17(24)18-11-22-19(26-18)23-6-4-21-5-7-23/h1-8,13,15,24H,9-12,14,23H2;2-6,11-12,14-15H,7-10,13,23H2,1H3;2-7,12-13,15H,8-11,14,23H2,1H3;2-8,13,15H,9-12,14,23H2,1H3;1-7,12,14,23H,8-11,13,22H2;1-3,8-9,11-12,21H,4-7,10,20H2
• InChIKey: FNKOBFUOLADIAK-UHFFFAOYSA-N
• XLogP: 18.38
• TPSA: 453.44 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 37
• Rotatable Bonds: 30
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2265.87
LogP ≤ 5	18.38
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone?

The IUPAC name of 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone (CID 158085088) is 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone.

What is the SMILES notation for 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone?

The canonical SMILES for 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone is CN1CCN(c2ccc(C(=O)Cc3cc(-c4ccco4)ccc3N)nc2)CC1.CN1CCN(c2ccc(C(=O)Cc3cc(-c4ccoc4)ccc3N)nc2)CC1.CN1CCN(c2ncc(C(=O)Cc3cc(-c4ccccc4)ccc3N)s2)CC1.Nc1ccc(-c2ccccc2)cc1CC(=O)c1cnc(N2CCNCC2)s1.Nc1ccc(-c2ccccn2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2ccoc2)cc1CC(=O)c1cnc(N2CCNCC2)s1.

What is the InChIKey of 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone?

The InChIKey is FNKOBFUOLADIAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O.2C22H24N4O2.C22H24N4OS.C21H22N4OS.C19H20N4O2S/c23-19-6-4-16(20-3-1-2-8-25-20)13-17(19)14-22(28)21-7-5-18(15-26-21)27-11-9-24-10-12-27;1-25-7-9-26(10-8-25)19-3-5-21(24-14-19)22(27)13-18-12-16(2-4-20(18)23)17-6-11-28-15-17;1-25-8-10-26(11-9-25)18-5-7-20(24-15-18)21(27)14-17-13-16(4-6-19(17)23)22-3-2-12-28-22;1-25-9-11-26(12-10-25)22-24-15-21(28-22)20(27)14-18-13-17(7-8-19(18)23)16-5-3-2-4-6-16;22-18-7-6-16(15-4-2-1-3-5-15)12-17(18)13-19(26)20-14-24-21(27-20)25-10-8-23-9-11-25;20-16-2-1-13(14-3-8-25-12-14)9-15(16)10-17(24)18-11-22-19(26-18)23-6-4-21-5-7-23/h1-8,13,15,24H,9-12,14,23H2;2-6,11-12,14-15H,7-10,13,23H2,1H3;2-7,12-13,15H,8-11,14,23H2,1H3;2-8,13,15H,9-12,14,23H2,1H3;1-7,12,14,23H,8-11,13,22H2;1-3,8-9,11-12,21H,4-7,10,20H2.

What are the key properties of 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone?

2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone has a molecular weight of 2265.87 g/mol, XLogP of 18.38, 30 rotatable bonds, 9 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-amino-5-(furan-2-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]ethanone;2-[2-amino-5-(furan-3-yl)phenyl]-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone;2-(2-amino-5-pyridin-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone is sourced from PubChem (CID 158085088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).